N-[(1S)-1-naphthalen-1-ylethyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(1S)-1-naphthalen-1-ylethyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(1S)-1-(1-naphthyl)ethyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(1S)-1-(1-naphthalenyl)ethyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(1S)-1-naphthalen-1-ylethyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[(1S)-1-(1-naphthyl)ethyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)CSC3=NN(C=N3)C4=CC=CC=C4

Isomeric SMILES

C[C@@H](C1=CC=CC2=CC=CC=C21)NC(=O)CSC3=NN(C=N3)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4OS/c1-16(19-13-7-9-17-8-5-6-12-20(17)19)24-21(27)14-28-22-23-15-26(25-22)18-10-3-2-4-11-18/h2-13,15-16H,14H2,1H3,(H,24,27)/t16-/m0/s1